Dimethylformamide → N-(2-(6-fluoro-1H-indol-3-yl)ethyl)-5-(3-fluorobenzyl)isoxazole-3-carboxamide

HRID 161486

Reaction equation

HRID 161486 reaction equation
[F:17][c:18]1[cH:19][cH:20][c:21]2[c:22]([CH2:27][CH2:28][NH2:29])[cH:23][nH:24][c:25]2[cH:26]1.[F:1][c:2]1[cH:3][c:4]([CH2:5][c:6]2[cH:7][c:8]([C:11](=[O:12])[OH:13])[n:9][o:10]2)[cH:14][cH:15][cH:16]1.[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[P-:30]([F:31])([F:32])([F:33])([F:34])([F:35])[F:36].[n:37]1([O:38][C:39]([N:40]([CH3:41])[CH3:42])=[N+:43]([CH3:44])[CH3:45])[c:46]2[n:47][cH:48][cH:49][cH:50][c:51]2[n:52][n:53]1>>[F:1][c:2]1[cH:3][c:4]([CH2:5][c:6]2[cH:7][c:8]([C:11](=[O:13])[NH:29][CH2:28][CH2:27][c:22]3[c:21]4[cH:20][cH:19][c:18]([F:17])[cH:26][c:25]4[nH:24][cH:23]3)[n:9][o:10]2)[cH:14][cH:15][cH:16]1

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 8540242-(6-fluoro-1H-indol-3-yl)ethanamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 668321075-(3-Fluorobenzyl)isoxazole-3-carboxylic acid

Product 1

HCID 66831760N-(2-(6-fluoro-1H-indol-3-yl)ethyl)-5-(3-fluorobenzyl)isoxazole-3-carboxamide

Sources & evidence

ORD record
ord-4b6437c6f61b407ab5d8178aabe663e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

Loading…